Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6698211

C1=CC([Hf+2](NC2CCCCCCCCCCC2)[SiH](c2ccccc2)c2ccccc2)c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.33
BCHE P06276 1/20 0.33
EPHX1 P07099 1/20 0.31
EPHX2 P34913 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
P2RX1 P51575 1/20 0.30
P2RX3 P56373 1/20 0.30
P2RX4 Q99571 1/20 0.30
P2RX7 Q99572 1/20 0.30
DUSP1 P28562 1/20 0.30
DUSP6 Q16828 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30
LMNA P02545 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL6694762 1.00 BCHE (0.33) BCHEACHEEPHX1EPHX2RAB9A
Hydrochloric Acid SCHEMBL6836594 0.84 BCHE (0.33) BCHEACHEP2RX1P2RX3P2RX4
Hydrochloric Acid SCHEMBL5853033 0.80 HPGD (0.39) EPHX2RAB9ASMN1; SMN2CYP2C19LMNA
Hydrochloric Acid SCHEMBL5852837 0.80 HPGD (0.39) EPHX2RAB9ASMN1; SMN2CYP2C19LMNA
Hydrochloric Acid SCHEMBL5853852 0.79 HPGD (0.37) EPHX2RAB9ASMN1; SMN2CYP2C19LMNA
Hydrochloric Acid SCHEMBL6840561 0.79
Hydrochloric Acid SCHEMBL6837860 0.76 SIGMAR1 (0.35) SMN1; SMN2TP53CYP3A4CYP2D6LMNA
Hydrochloric Acid SCHEMBL5853720 0.75 SIGMAR1 (0.30)
Hydrochloric Acid SCHEMBL5853701 0.73
Hydrochloric Acid SCHEMBL217385 0.73 HTR6 (0.32)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed